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Reaction cross sections and rate constants for the F+H₂(D₂)→HF(DF)+H(D) reactions from quasiclassical trajectory calculations on a potential energy surface

F. Aoiz, L. Bañares, V. Herrero, K. Stark, and H. Werner. Chem. Phys. Lett., 254 (5-6): 341–348 (1996)
DOI: 10.1016/0009-2614(96)00316-8

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Sven Stark University of Stuttgart

K. Stahl

K. Gaiser

K. Lindow

Tim Stark University of Stuttgart

Other publications of authors with the same name

Integral and differential state‐to‐state cross‐sections for the reactions F⁺D₂(vᵢ=0, jᵢ)→DF(v_f,j_f)+D: A comparison between three‐dimensional quantum mechanical and experimental resultsM. Baer, M. Faubel, B. Martinez‐Haya, L. Rusin, U. Tappe, J. Toennies, K. Stark, and H. Werner. J. Chem. Phys., 104 (7): 2743–2745 (1996)Quasi-Classical Trajectory Study of the F + D₂ .fwdarw. DF + D Reaction on a New ab Initio Potential Energy Surface. Comparison with Molecular Beam Experimental ResultsV. Saez Rabanos, K. Stark, L. Banares, H. Werner, F. Aoiz, and V. Herrero. J. Phys. Chem., 98 (42): 10665–10670 (2005)The Transition State of the F + H₂ ReactionS. Bradforth, K. Stark, D. Arnold, D. Manolopoulos, D. Neumark, and H. Werner. Science (80-. )., 262 (5141): 1852–1855 (2006)Reaction cross sections and rate constants for the F+H₂(D₂)→HF(DF)+H(D) reactions from quasiclassical trajectory calculations on a potential energy surfaceF. Aoiz, L. Bañares, V. Herrero, K. Stark, and H. Werner. Chem. Phys. Lett., 254 (5-6): 341–348 (1996)The F + HD reaction: Cross sections and rate constants on an ab initio potential energy surfaceF. Aoiz, L. Bañares, V. Herrero, V. Sáez Rábanos, K. Stark, I. Tanarro, and H. Werner. Chem. Phys. Lett., 262 (3-4): 175–182 (1996)A globally-applicable disease ontology for biosurveillance; Anthology of Biosurveillance Diseases (ABD).A. Daughton, R. Priedhorsky, G. Fairchild, N. Generous, A. Hengartner, E. Abeyta, N. Velappan, A. Lillo, K. Stark, and A. Deshpande. CoRR, (2016)The F+HD→DF(HF)+H(D) reaction revisited: Quasiclassical trajectory study on an ab initio potential energy surface and comparison with molecular beam experimentsF. Aoiz, L. Bañares, V. Herrero, V. Sáez Rábanos, K. Stark, and H. Werner. J. Chem. Phys., 102 (23): 9248–9262 (1995)Classical dynamics for the F + H₂ → HF + H reaction on a new ab initio potential energy surface. A direct comparison with experimentF. Aoiz, L. Bañares, V. Herrero, V. Sáez Rábanos, K. Stark, and H. Werner. Chem. Phys. Lett., 223 (3): 215–226 (1994)Ab Initio Simulation of Molecular Beam Experiments for the F + H₂ → HF + H ReactionK. Stark, J. Castillo, B. Martínez-Haya, L. Bañares, H. Werner, F. Aoiz, and D. Manolopoulos. J. Phys. Chem. A, 101 (36): 6403–6414 (2002)

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